Oxazolo(3,2-d)(1,4)benzodiazepin-6(5H)-one, 2,3,7,11b-tetrahydro-10-chloro-11b-phenyl-
Basic information
- CAS
24143-15-5- Standard SMILES
O=C1CN2CCOC2(c2ccccc2)c2cc(Cl)ccc2N1- InChIKey
RXBFMQCMKZAQJL-UHFFFAOYSA-N- Molecular formula
- C17H15ClN2O2
- Average molar mass
- 314.8 g/mol
- Monoisotopic mass
- 314.0822054
Names & identifiers
- Preferred name
- Oxazolo(3,2-d)(1,4)benzodiazepin-6(5H)-one, 2,3,7,11b-tetrahydro-10-chloro-11b-phenyl-
- IUPAC
- 10-chloro-11b-phenyl-2,3,5,7-tetrahydro-[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6-one
Names & synonyms
BRN 056430524143-15-52,3,7,11b-Tetrahydro-10-chloro-11b-phenyloxazolo(3,2-d)(1,4)benzodiazepin-6(5H)-oneOxazolo(3,2-d)(1,4)benzodiazepin-6(5H)-one, 2,3,7,11b-tetrahydro-10-chloro-11b-phenyl-RefChem:367312SCHEMBL11684550DTXSID9094696310-Chloro-11b-phenyl-2,3,5,11b-tetrahydro[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6-ol
Database identifiers
- CAS
24143-15-5- PubChem CID
- 212322
- DTXSID
DTXSID90946963
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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